Geometry & MOs

Info

ID:	257490
PubChem CID:	103146570
Reduced:	NSO3F6H7C9 (1)
Stoich.:	ABC3D6E7F9 (1)
Weight, g/mol:	277.058421
ΔH_f, kcal/mol:	-412.96
Dipole, Da:	5.22
IP(EA), eV:	-10.67(-2.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclopropyl-2-[2-(2,2-difluoroethoxy)ethyl]-1,3-thiazole-5-carboxylic acid

Drug info:

PubChemData

Smile

C(COCC(F)(F)F)C1=NC(=C(S1)C(=O)O)C(F)(F)F

DOS

IR

Vibrations